2-(3,3,5,5-tetramethyl-1-oxidanylidene-piperazin-1-ium-2-yl)ethyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate

Systemtic Name: 2-(3,3,5,5-tetramethyl-1-oxidanylidene-piperazin-1-ium-2-yl)ethyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-oxidanyl-phenyl]propanoate Openeye Name: 2-(3,3,5,5-tetramethyl-1-oxo-piperazin-1-ium-2-yl)ethyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propanoate CAS Name: 3-[3-(2-benzotriazolyl)-5-tert-butyl-4-hydroxyphenyl]propanoic acid 2-(3,3,5,5-tetramethyl-1-oxo-2-piperazin-1-iumyl)ethyl ester IUPAC Name: 2-(3,3,5,5-tetramethyl-1-oxopiperazin-1-ium-2-yl)ethyl 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxyphenyl]propanoate Traditional Name: 3-[3-(benzotriazol-2-yl)-5-tert-butyl-4-hydroxy-phenyl]propionic acid 2-(1-keto-3,3,5,5-tetramethyl-piperazin-1-ium-2-yl)ethyl ester Formula: C29H40N5O4+ MolecularWeight: 522.659

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Descriptors Computed from Structure

Canonical SMILES:

CC1(C[N+](=O)C(C(N1)(C)C)CCOC(=O)CCC2=CC(=C(C(=C2)N3N=C4C=CC=CC4=N3)O)C(C)(C)C)C

Isomeric SMILES

CC1(C[N+](=O)C(C(N1)(C)C)CCOC(=O)CCC2=CC(=C(C(=C2)N3N=C4C=CC=CC4=N3)O)C(C)(C)C)C

InChI

InChI=1S/C29H39N5O4/c1-27(2,3)20-16-19(17-23(26(20)36)34-30-21-10-8-9-11-22(21)31-34)12-13-25(35)38-15-14-24-29(6,7)32-28(4,5)18-33(24)37/h8-11,16-17,24,32H,12-15,18H2,1-7H3/p+1